2-[[2-[[3,5-bis(oxidanylidene)-1-phenyl-pyrazolidin-4-ylidene]methyl]-6-methoxy-phenoxy]methyl]benzenecarbonitrile

Systemtic Name: 2-[[2-[[3,5-bis(oxidanylidene)-1-phenyl-pyrazolidin-4-ylidene]methyl]-6-methoxy-phenoxy]methyl]benzenecarbonitrile Openeye Name: 2-[[2-[(3,5-dioxo-1-phenyl-pyrazolidin-4-ylidene)methyl]-6-methoxy-phenoxy]methyl]benzonitrile CAS Name: 2-[[2-[(3,5-dioxo-1-phenyl-4-pyrazolidinylidene)methyl]-6-methoxyphenoxy]methyl]benzonitrile IUPAC Name: 2-[[2-[(3,5-dioxo-1-phenylpyrazolidin-4-ylidene)methyl]-6-methoxyphenoxy]methyl]benzonitrile Traditional Name: 2-[[2-[(3,5-diketo-1-phenyl-pyrazolidin-4-ylidene)methyl]-6-methoxy-phenoxy]methyl]benzonitrile Formula: C25H19N3O4 MolecularWeight: 425.43606

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OCC2=CC=CC=C2C#N)C=C3C(=O)NN(C3=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1OCC2=CC=CC=C2C#N)C=C3C(=O)NN(C3=O)C4=CC=CC=C4

InChI

InChI=1S/C25H19N3O4/c1-31-22-13-7-10-17(23(22)32-16-19-9-6-5-8-18(19)15-26)14-21-24(29)27-28(25(21)30)20-11-3-2-4-12-20/h2-14H,16H2,1H3,(H,27,29)